methyl 5-butanoyl-6-methyl-1H-benzimidazole-2-carboxylate

Systemtic Name: methyl 5-butanoyl-6-methyl-1H-benzimidazole-2-carboxylate Openeye Name: methyl 5-butanoyl-6-methyl-1H-benzimidazole-2-carboxylate CAS Name: 6-methyl-5-(1-oxobutyl)-1H-benzimidazole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-butanoyl-6-methyl-1H-benzimidazole-2-carboxylate Traditional Name: 5-butyryl-6-methyl-1H-benzimidazole-2-carboxylic acid methyl ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1C)NC(=N2)C(=O)OC

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1C)NC(=N2)C(=O)OC

InChI

InChI=1S/C14H16N2O3/c1-4-5-12(17)9-7-11-10(6-8(9)2)15-13(16-11)14(18)19-3/h6-7H,4-5H2,1-3H3,(H,15,16)